ChemSpider 2D Image | (2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-2,3-dihydro-4H-chromen-4-one | C16H14O6

(2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-2,3-dihydro-4H-chromen-4-one

  • Molecular FormulaC16H14O6
  • Average mass302.279 Da
  • Monoisotopic mass302.079041 Da
  • ChemSpider ID28424403

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-2,3-dihydro-4H-chromen-4-on [German] [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-2,3-dihydro-4H-chromen-4-one [ACD/IUPAC Name]
(2S)-5,7-Dihydroxy-2-(4-hydroxyphényl)-6-méthoxy-2,3-dihydro-4H-chromén-4-one [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 2,3-dihydro-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-, (2S)- [ACD/Index Name]
(2S)-4',5,7-Trihydroxy-6-methoxyflavanone
(2S)-5,7-dihydroxy-2-(4-hydroxyphenyl)-6-methoxy-2,3-dihydrochromen-4-one
6-methoxynaringenin
94942-49-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 605.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 230.6±25.0 °C
Index of Refraction: 1.665
Molar Refractivity: 76.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.00
ACD/LogD (pH 5.5): 2.70
ACD/BCF (pH 5.5): 66.50
ACD/KOC (pH 5.5): 698.49
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 27.09
ACD/KOC (pH 7.4): 284.55
Polar Surface Area: 96 Å2
Polarizability: 30.5±0.5 10-24cm3
Surface Tension: 67.5±3.0 dyne/cm
Molar Volume: 207.3±3.0 cm3

Click to predict properties on the Chemicalize site


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